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Science 2 April 2004:
Vol. 304. no. 5667, pp. 84 - 87
DOI: 10.1126/science.1093902
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Reports

Formation of Al13I-: Evidence for the Superhalogen Character of Al13

Denis E. Bergeron,1 A. Welford Castleman, Jr.,1* Tsuguo Morisato,2 Shiv N. Khanna2

Al13– is a cluster known for the pronounced stability that arises from coincident closures of its geometric and electronic shells. We present experimental evidence for a very stable cluster corresponding to Al13I–. Ab initio calculations show that the cluster features a structurally unperturbed Al13– core and a region of high charge density on the aluminum vertex opposite from the iodine atom. This ionically bound magic cluster can be understood by considering that Al13 has an electronic structure reminiscent of a halogen atom. Comparisons to polyhalides provide a sound explanation for our chemical observations.

1 Departments of Chemistry and Physics, Pennsylvania State University, University Park, PA 16802, USA.
2 Department of Physics, Virginia Commonwealth University, Richmond, VA 23284, USA.

* To whom correspondence should be addressed. E-mail: awc{at}psu.edu

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THIS ARTICLE HAS BEEN CITED BY OTHER ARTICLES:
Spin Conservation Accounts for Aluminum Cluster Anion Reactivity Pattern with O2.
R. Burgert, H. Schnockel, A. Grubisic, X. Li, S. T. Stokes, K. H. Bowen, G. F. Gantefor, B. Kiran, and P. Jena (2008)
Science 319, 438-442
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Al4HFormula is a resilient building block for aluminum hydrogen cluster materials.
P. J. Roach, A. C. Reber, W. H. Woodward, S. N. Khanna, and A. W. Castleman Jr. (2007)
PNAS 104, 14565-14569
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Multiple valence superatoms.
J. U. Reveles, S. N. Khanna, P. J. Roach, and A. W. Castleman Jr. (2006)
PNAS 103, 18405-18410
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Cluster Chemistry And Dynamics Special Feature: Clusters: A bridge across the disciplines of environment, materials science, and biology..
A. W. Castleman Jr. and P. Jena (2006)
PNAS 103, 10554-10559
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Al Cluster Superatoms as Halogens in Polyhalides and as Alkaline Earths in Iodide Salts.
D. E. Bergeron, P. J. Roach, A. W. Castleman Jr., N. O. Jones, and S. N. Khanna (2005)
Science 307, 231-235
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Science. ISSN 0036-8075 (print), 1095-9203 (online)